| ## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
| Id |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
| 1 |
1 |
|
A |
73 |
19 |
11790 |
◊ |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
73 |
20 |
11867 |
615.1 |
-2.8 |
0.512 |
4 |
8 |
0 |
0.000 |
| 2 |
2 |
|
C |
50 |
15 |
12002 |
◊ |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
57 |
20 |
11790 |
479.9 |
0.5 |
0.727 |
9 |
5 |
0 |
0.000 |
| 3 |
3 |
|
A |
51 |
15 |
11790 |
◊ |
C |
-x,y-1/2,-z+3/2 |
3_546 |
44 |
16 |
12002 |
423.8 |
-2.7 |
0.415 |
6 |
4 |
0 |
0.000 |
4 |
|
B |
50 |
16 |
11867 |
◊ |
A |
x,y,z |
1_555 |
40 |
14 |
11790 |
417.3 |
-1.7 |
0.489 |
6 |
5 |
0 |
0.000 |
| Average: |
420.5 |
-2.2 |
0.452 |
6 |
5 |
0 |
0.000 |
| 4 |
5 |
|
[235]B:501 |
30 |
1 |
641 |
f |
B |
x,y,z |
1_555 |
59 |
23 |
11867 |
423.5 |
1.5 |
0.804 |
11 |
0 |
0 |
0.008 |
6 |
|
[235]C:601 |
30 |
1 |
643 |
f |
C |
x,y,z |
1_555 |
53 |
22 |
12002 |
415.7 |
1.5 |
0.800 |
11 |
0 |
0 |
0.008 |
7 |
|
[235]A:401 |
30 |
1 |
646 |
f |
A |
x,y,z |
1_555 |
50 |
22 |
11790 |
412.6 |
1.3 |
0.799 |
11 |
0 |
0 |
0.008 |
| Average: |
417.2 |
1.4 |
0.801 |
11 |
0 |
0 |
0.008 |
| 5 |
8 |
|
C |
44 |
13 |
12002 |
x |
C |
x-1/2,-y+1/2,-z+2 |
4_457 |
49 |
13 |
12002 |
399.4 |
-2.3 |
0.319 |
6 |
0 |
0 |
0.000 |
| 6 |
9 |
|
A |
32 |
10 |
11790 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
34 |
13 |
11867 |
300.6 |
-3.2 |
0.187 |
0 |
1 |
0 |
0.000 |
| 7 |
10 |
|
B |
24 |
8 |
11867 |
◊ |
C |
-x+1,y-1/2,-z+3/2 |
3_646 |
23 |
7 |
12002 |
207.0 |
-0.7 |
0.527 |
3 |
0 |
0 |
0.000 |
| 8 |
11 |
|
A |
20 |
10 |
11790 |
◊ |
C |
-x+1,y-1/2,-z+3/2 |
3_646 |
20 |
8 |
12002 |
191.5 |
-0.0 |
0.468 |
1 |
0 |
0 |
0.000 |
| 9 |
12 |
|
B |
25 |
11 |
11867 |
◊ |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
22 |
11 |
11790 |
189.4 |
-2.8 |
0.256 |
0 |
2 |
0 |
0.000 |
| 10 |
13 |
|
C |
18 |
6 |
12002 |
◊ |
B |
x-1/2,-y+1/2,-z+2 |
4_457 |
19 |
8 |
11867 |
172.9 |
-2.2 |
0.272 |
2 |
0 |
0 |
0.000 |
| 11 |
14 |
|
C |
20 |
8 |
12002 |
◊ |
B |
x,y,z |
1_555 |
19 |
6 |
11867 |
157.5 |
-1.6 |
0.381 |
0 |
0 |
0 |
0.000 |
| 12 |
15 |
|
B |
13 |
6 |
11867 |
◊ |
C |
-x,y-1/2,-z+3/2 |
3_546 |
12 |
6 |
12002 |
114.7 |
-0.2 |
0.394 |
1 |
0 |
0 |
0.000 |
| 13 |
16 |
|
[ZN]B:500 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
8 |
6 |
11867 |
36.7 |
-26.5 |
0.000 |
0 |
0 |
0 |
0.061 |
17 |
|
[ZN]C:600 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
9 |
6 |
12002 |
36.5 |
-26.3 |
0.000 |
0 |
0 |
0 |
0.061 |
18 |
|
[ZN]A:400 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
7 |
6 |
11790 |
36.5 |
-26.5 |
0.000 |
0 |
0 |
0 |
0.061 |
| Average: |
36.6 |
-26.4 |
0.000 |
0 |
0 |
0 |
0.061 |
| 14 |
19 |
|
A |
6 |
3 |
11790 |
◊ |
C |
-x+1/2,-y,z-1/2 |
2_554 |
4 |
2 |
12002 |
30.6 |
-0.2 |
0.510 |
0 |
0 |
0 |
0.000 |
| 15 |
20 |
|
[235]A:401 |
6 |
1 |
646 |
f |
[ZN]A:400 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.4 |
-13.4 |
0.000 |
0 |
0 |
0 |
0.031 |
21 |
|
[235]C:601 |
6 |
1 |
643 |
f |
[ZN]C:600 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.3 |
-13.5 |
0.000 |
0 |
0 |
0 |
0.031 |
22 |
|
[235]B:501 |
6 |
1 |
641 |
f |
[ZN]B:500 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.0 |
-13.4 |
0.000 |
0 |
0 |
0 |
0.031 |
| Average: |
30.3 |
-13.4 |
0.000 |
0 |
0 |
0 |
0.031 |
| 16 |
23 |
|
C |
4 |
2 |
12002 |
◊ |
B |
x-1,y,z |
1_455 |
3 |
2 |
11867 |
28.8 |
1.0 |
0.888 |
2 |
2 |
0 |
0.000 |
| 17 |
24 |
|
B |
2 |
1 |
11867 |
x |
B |
-x+1,y-1/2,-z+3/2 |
3_646 |
1 |
1 |
11867 |
14.8 |
-0.1 |
0.457 |
0 |
0 |
0 |
0.000 |
|